1-[4-methyl-3-[3-(2-methylpropylamino)-2-oxidanyl-propoxy]thiophen-2-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-methyl-3-[3-(2-methylpropylamino)-2-oxidanyl-propoxy]thiophen-2-yl]-3-phenyl-propan-1-one Openeye Name: 1-[3-[2-hydroxy-3-(isobutylamino)propoxy]-4-methyl-2-thienyl]-3-phenyl-propan-1-one CAS Name: 1-[3-[2-hydroxy-3-(2-methylpropylamino)propoxy]-4-methyl-2-thiophenyl]-3-phenyl-1-propanone IUPAC Name: 1-[3-[2-hydroxy-3-(2-methylpropylamino)propoxy]-4-methylthiophen-2-yl]-3-phenylpropan-1-one Traditional Name: 1-[3-[2-hydroxy-3-(isobutylamino)propoxy]-4-methyl-2-thienyl]-3-phenyl-propan-1-one Formula: C21H29NO3S MolecularWeight: 375.52486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1OCC(CNCC(C)C)O)C(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC1=CSC(=C1OCC(CNCC(C)C)O)C(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H29NO3S/c1-15(2)11-22-12-18(23)13-25-20-16(3)14-26-21(20)19(24)10-9-17-7-5-4-6-8-17/h4-8,14-15,18,22-23H,9-13H2,1-3H3